SCHEMBL4133054

SCHEMBL4133054

CC(C)(C)OC(=O)N[C@@H]1C=C(c2ccncc2[N+](=O)[O-])CC[C@H]1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
DPP4 P27487 1/20 0.31
DRD2 P14416 1/20 0.31
CCNC P24863 1/20 0.30
CDK8 P49336 1/20 0.30
HASPIN Q8TF76 1/20 0.30
BRS3 P32247 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2693885 1.00 GPR119 (0.33) GPR119MEN1KMT2ADPP4DRD2
SCHEMBL1711202 0.90 MEN1 (0.33) MEN1KMT2A
SCHEMBL1711198 0.90 MEN1 (0.33) MEN1KMT2A
SCHEMBL2694440 0.87 BRS3 (0.34) GPR119MEN1KMT2ADPP4DRD2
SCHEMBL11912165 0.87 BRS3 (0.34) GPR119MEN1KMT2ADPP4DRD2
SCHEMBL13421779 0.86 GPR119 (0.34) GPR119CCNCCDK8HASPINBRS3
SCHEMBL4131924 0.86 GPR119 (0.34) GPR119CCNCCDK8HASPINBRS3
SCHEMBL2833150 0.86 GPR119 (0.34) GPR119CCNCCDK8HASPINBRS3
SCHEMBL4126871 0.86 KMT2A (0.34) GPR119MEN1KMT2ADPP4DRD2
SCHEMBL2693491 0.86 KMT2A (0.34) GPR119MEN1KMT2ADPP4DRD2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8829193-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-09 US disclosed
EP-2262802-B1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2013-10-23 EP disclosed
EP-2596790-A1 Pim kinase inhibitors and methods of their use Novartis AG (CH) 2013-05-29 EP disclosed
US-20120202851-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-09 US disclosed
US-8168794-B2 Pim kinase inhibitors and methods of their use NOVARTIS AG (CH) 2012-05-01 US disclosed
US-20100216839-A1 Pim kinase inhibitors and methods of their use NOVARTIS AG (CH) 2010-08-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100216839-A1 Pim kinase inhibitors and methods of their use PIM1, PIM2, PIM3 GPR119 1000/4885MEN1 3664/4885KMT2A 1446/4885
US-20120202851-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 GPR119 1000/4885MEN1 3664/4885KMT2A 1446/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.